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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL1614665
CHEMBL1614665
Compound Name CEFCLIDIN
ChEMBL Synonyms CEFCLIDIN
Max Phase 0
Trade Names
Molecular Formula C21H26N8O6S2

Additional synonyms for CHEMBL1614665 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES CO\N=C(/C(=O)N[C@H]1[C@H]2SCC(=C(N2C1=O)C(=O)[O-])C[N+]34CCC ...
Download SMILES
Standard InChI InChI=1S/C21H26N8O6S2/c1-35-26-11(14-25-20(23)37-27-14)15(30 ...
Download InChI
Standard InChI Key JUVHVMCKLDZLGN-TVNFHGJBSA-N

Sources

  • Scientific Literature
  • USP Dictionary of USAN and International Drug Names

Alternate Forms of Compound in ChEMBL


CHEMBL1614665

Molecule Features

CHEMBL1614665 compound icon
Drug Type:Natural Product-derived Rule of Five:N First In Class:N Chirality:Single Stereoisomer Prodrug:N Oral:Unclassified Parenteral:Unclassified Topical:Unclassified Black Box:Unclassified Availability Type:Unclassified

Clinical Data

ClinicalTrials.gov CEFCLIDIN
The Cochrane Collaboration CEFCLIDIN

Compound Bioactivity Summary

Compound Assay Summary

Compound Target Summary

Calculated Compound Parent Properties

Mol. Weight Mol. Weight Monoisotopic ALogP #Rotatable Bonds Polar Surface Area Molecular Species
550.6 550.1417 -4.41 8 259.56 ACID


HBA HBD #Ro5 Violations HBA (Lipinski) HBD (Lipinski) #Ro5 Violations (Lipinski)
11 3 2 14 5 1


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
2.07 - -3.74 -3.26 1 37 0.12

Structural Alerts

There are 14 structural alerts for CHEMBL1614665. To view alerts please click here.

Compound Cross References

ChemSpider ChemSpider:JUVHVMCKLDZLGN-TVNFHGJBSA-N
Wikipedia Cefclidine

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL1614665



ACToR 114013-51-3
ChEBI 3484
EPA CompTox Dashboard DTXSID80147023
FDA SRS 78963CJ0OG
KEGG Ligand C11202
PubChem 6537446 57507213
PubChem: Drugs of the Future 12013984
PubChem: Thomson Pharma 14837266 24738264
SureChEMBL SCHEMBL1649323

UniChem REST Service Call:
https://www.ebi.ac.uk/unichem/rest/verbose_inchikey/JUVHVMCKLDZLGN-TVNFHGJBSA-N spacer
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